5-(5-chloranyl-2-methoxy-phenyl)-3-[3-(4-methoxyphenoxy)propylsulfanyl]-1H-1,2,4-triazole

Systemtic Name: 5-(5-chloranyl-2-methoxy-phenyl)-3-[3-(4-methoxyphenoxy)propylsulfanyl]-1H-1,2,4-triazole Openeye Name: 5-(5-chloro-2-methoxy-phenyl)-3-[3-(4-methoxyphenoxy)propylsulfanyl]-1H-1,2,4-triazole CAS Name: 5-(5-chloro-2-methoxyphenyl)-3-[3-(4-methoxyphenoxy)propylthio]-1H-1,2,4-triazole IUPAC Name: 5-(5-chloro-2-methoxyphenyl)-3-[3-(4-methoxyphenoxy)propylsulfanyl]-1H-1,2,4-triazole Traditional Name: 5-(5-chloro-2-methoxy-phenyl)-3-[3-(4-methoxyphenoxy)propylthio]-1H-1,2,4-triazole Formula: C19H20ClN3O3S MolecularWeight: 405.8984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OCCCSC2=NNC(=N2)C3=C(C=CC(=C3)Cl)OC

Isomeric SMILES

COC1=CC=C(C=C1)OCCCSC2=NNC(=N2)C3=C(C=CC(=C3)Cl)OC

InChI

InChI=1S/C19H20ClN3O3S/c1-24-14-5-7-15(8-6-14)26-10-3-11-27-19-21-18(22-23-19)16-12-13(20)4-9-17(16)25-2/h4-9,12H,3,10-11H2,1-2H3,(H,21,22,23)